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Title: Materials Data on TiCdO3 by Materials Project

Abstract

CdTiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ti4+ is bonded to six equivalent O2- atoms to form TiO6 octahedra that share corners with six equivalent TiO6 octahedra and faces with eight equivalent CdO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ti–O bond lengths are 1.94 Å. Cd2+ is bonded to twelve equivalent O2- atoms to form CdO12 cuboctahedra that share corners with twelve equivalent CdO12 cuboctahedra, faces with six equivalent CdO12 cuboctahedra, and faces with eight equivalent TiO6 octahedra. All Cd–O bond lengths are 2.75 Å. O2- is bonded in a distorted linear geometry to two equivalent Ti4+ and four equivalent Cd2+ atoms.

Publication Date:
Other Number(s):
mp-1016846
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; TiCdO3; Cd-O-Ti
OSTI Identifier:
1349458
DOI:
https://doi.org/10.17188/1349458

Citation Formats

The Materials Project. Materials Data on TiCdO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1349458.
The Materials Project. Materials Data on TiCdO3 by Materials Project. United States. doi:https://doi.org/10.17188/1349458
The Materials Project. 2020. "Materials Data on TiCdO3 by Materials Project". United States. doi:https://doi.org/10.17188/1349458. https://www.osti.gov/servlets/purl/1349458. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1349458,
title = {Materials Data on TiCdO3 by Materials Project},
author = {The Materials Project},
abstractNote = {CdTiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ti4+ is bonded to six equivalent O2- atoms to form TiO6 octahedra that share corners with six equivalent TiO6 octahedra and faces with eight equivalent CdO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ti–O bond lengths are 1.94 Å. Cd2+ is bonded to twelve equivalent O2- atoms to form CdO12 cuboctahedra that share corners with twelve equivalent CdO12 cuboctahedra, faces with six equivalent CdO12 cuboctahedra, and faces with eight equivalent TiO6 octahedra. All Cd–O bond lengths are 2.75 Å. O2- is bonded in a distorted linear geometry to two equivalent Ti4+ and four equivalent Cd2+ atoms.},
doi = {10.17188/1349458},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}